(4-nitrophenyl) 4-methylsulfonyl-2-nitro-benzoate

Systemtic Name: (4-nitrophenyl) 4-methylsulfonyl-2-nitro-benzoate Openeye Name: (4-nitrophenyl) 4-methylsulfonyl-2-nitro-benzoate CAS Name: 4-methylsulfonyl-2-nitrobenzoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 4-methylsulfonyl-2-nitrobenzoate Traditional Name: 4-mesyl-2-nitro-benzoic acid (4-nitrophenyl) ester Formula: C14H10N2O8S MolecularWeight: 366.3028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H10N2O8S/c1-25(22,23)11-6-7-12(13(8-11)16(20)21)14(17)24-10-4-2-9(3-5-10)15(18)19/h2-8H,1H3